(phenylmethyl) 3-[[(3-chloranylpyrazin-2-yl)amino]methyl]-8-azabicyclo[3.2.1]octane-8-carboxylate

Systemtic Name: (phenylmethyl) 3-[[(3-chloranylpyrazin-2-yl)amino]methyl]-8-azabicyclo[3.2.1]octane-8-carboxylate Openeye Name: benzyl 3-[[(3-chloropyrazin-2-yl)amino]methyl]-8-azabicyclo[3.2.1]octane-8-carboxylate CAS Name: 3-[[(3-chloro-2-pyrazinyl)amino]methyl]-8-azabicyclo[3.2.1]octane-8-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[[(3-chloropyrazin-2-yl)amino]methyl]-8-azabicyclo[3.2.1]octane-8-carboxylate Traditional Name: 3-[[(3-chloropyrazin-2-yl)amino]methyl]-8-azabicyclo[3.2.1]octane-8-carboxylic acid benzyl ester Formula: C20H23ClN4O2 MolecularWeight: 386.87522

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC(CC1N2C(=O)OCC3=CC=CC=C3)CNC4=NC=CN=C4Cl

Isomeric SMILES

C1CC2CC(CC1N2C(=O)OCC3=CC=CC=C3)CNC4=NC=CN=C4Cl

InChI

InChI=1S/C20H23ClN4O2/c21-18-19(23-9-8-22-18)24-12-15-10-16-6-7-17(11-15)25(16)20(26)27-13-14-4-2-1-3-5-14/h1-5,8-9,15-17H,6-7,10-13H2,(H,23,24)